Ensemble refinement model

PDB 4C66|dpdb_g5pb77sv

Ensemble refinement model

Discovery of Epigenetic Regulator I-BET762: Lead Optimization to Afford a Clinical Candidate Inhibitor of the BET Bromodomains

Program
PHENIX 2.0_5824
Model type
Ensemble
Purpose
Refinement
Atoms
114,231
Residues
126
Protein chains
1
Alternate-location fraction
0%
Ligand
H4C

Evaluations

R-work
0.184
R-free
0.235
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
BROMODOMAIN-CONTAINING PROTEIN 4126
  • ConstructN-TERMINAL BROMODOMAIN, RESIDUES 44-167

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations